S-(1,5-diphenylpentan-3-yl) 1-(cyclohexylcarbamoyl)piperidine-2-carbothioate

Systemtic Name: S-(1,5-diphenylpentan-3-yl) 1-(cyclohexylcarbamoyl)piperidine-2-carbothioate Openeye Name: S-(1-phenethyl-3-phenyl-propyl) 1-(cyclohexylcarbamoyl)piperidine-2-carbothioate CAS Name: 1-[(cyclohexylamino)-oxomethyl]-2-piperidinecarbothioic acid S-(1,5-diphenylpentan-3-yl) ester IUPAC Name: S-(1,5-diphenylpentan-3-yl) 1-(cyclohexylcarbamoyl)piperidine-2-carbothioate Traditional Name: 1-(cyclohexylcarbamoyl)piperidine-2-carbothioic acid S-(1-phenethyl-3-phenyl-propyl) ester Formula: C30H40N2O2S MolecularWeight: 492.7158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCCC2C(=O)SC(CCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCCCC2C(=O)SC(CCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C30H40N2O2S/c33-29(28-18-10-11-23-32(28)30(34)31-26-16-8-3-9-17-26)35-27(21-19-24-12-4-1-5-13-24)22-20-25-14-6-2-7-15-25/h1-2,4-7,12-15,26-28H,3,8-11,16-23H2,(H,31,34)